SCHEMBL3625815

SCHEMBL3625815

CCc1cn(-c2cc(F)c(C#N)c(NC3CCOC3)c2)c2c1C(=O)CC(C)(C)C2

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 16/20 0.60
HSP90AA1 P07900 15/20 0.60
HSP90B1 P14625 6/20 0.60
TRAP1 Q12931 4/20 0.60
BCL6 P41182 1/20 0.34
FASN P49327 2/20 0.32
ALK Q9UM73 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3634090 0.90 HSP90AB1 (0.73) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL3634084 0.90 HSP90AB1 (0.73) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL3632104 0.88 HSP90AA1 (0.59) HSP90AB1HSP90AA1HSP90B1TRAP1BCL6
SCHEMBL3632107 0.88 HSP90AA1 (0.59) HSP90AB1HSP90AA1HSP90B1TRAP1BCL6
SCHEMBL3625989 0.85 HSP90AA1 (0.82) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL3625988 0.85 HSP90AA1 (0.82) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL12820977 0.81 HSP90AA1 (0.58) HSP90AB1HSP90AA1HSP90B1TRAP1BCL6
SCHEMBL12821044 0.81 HSP90AA1 (0.62) HSP90AB1HSP90AA1HSP90B1TRAP1BCL6
SCHEMBL3631673 0.79 HSP90AB1 (0.53) HSP90AB1HSP90AA1HSP90B1TRAP1
SCHEMBL8136169 0.78 HSP90AA1 (0.67) HSP90AB1HSP90AA1HSP90B1TRAP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2146967-A2 TETRAHYDROINDOLE AND TETRAHYDROINDAZOLE DERIVATIVES Serenex, Inc. (US) 2010-01-27 EP disclosed
WO-2008130879-A2 TETRAHYDROINDOLE AND TETRAHYDROINDAZOLE DERIVATIVES SERENEX, INC. (US) 2008-10-30 WO disclosed
US-20080269193-A1 Tetrahydroindole and Tetrahydroindazole Derivatives SERENEX, INC. 2008-10-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080269193-A1 Tetrahydroindole and Tetrahydroindazole Derivatives HSF1, HSP90AB1, TPH1 HSP90AB1 2/4885HSP90AA1 4/4885HSP90B1 13/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.